Monomers

Methyl acrylate

Identifiers

IUPAC name
methyl prop-2-enoate
InchI
InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3
InchI Key
BAPJBEWLBFYGME-UHFFFAOYSA-N
SMILES
COC(=O)C=C
Canonical SMILES
COC(=O)C=C
Isomeric SMILES
COC(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
26.3
MolLogP
0.3454
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 12 11  0  0  0  0  0  0  0  0999 V2000
   -2.2952   -0.0914   -0.1201 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0405   -0.7428   -0.0556 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0854    0.0646    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0596    1.3327    0.0093 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4003   -0.5441    0.0780 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4706    0.2197    0.1403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4383    0.5344    0.7782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2933    0.6154   -0.9855 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1258   -0.8347   -0.2626 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4858   -1.6160    0.0766 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3568    1.2821    0.1401 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4538   -0.2201    0.1912 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  1  7  1  0
  1  8  1  0
  1  9  1  0
  5 10  1  0
  6 11  1  0
  6 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers